1'-cyclopropyl-N-ethylspiro[3,4-dihydrochromene-2,3'-pyrrolidine]-4-amine

C17H24N2O — CID 114712252

IUPAC1'-cyclopropyl-N-ethylspiro[3,4-dihydrochromene-2,3'-pyrrolidine]-4-amine
SMILESCCNC1CC2(CCN(C3CC3)C2)Oc2ccccc21
InChIInChI=1S/C17H24N2O/c1-2-18-15-11-17(9-10-19(12-17)13-7-8-13)20-16-6-4-3-5-14(15)16/h3-6,13,15,18H,2,7-12H2,1H3
InChIKeyCPLMVGQYKPDYDD-UHFFFAOYSA-N
MW272.39 g/mol
LogP2.73
Rot. Bonds3

About 1'-cyclopropyl-N-ethylspiro[3,4-dihydrochromene-2,3'-pyrrolidine]-4-amine

1'-cyclopropyl-N-ethylspiro[3,4-dihydrochromene-2,3'-pyrrolidine]-4-amine (PubChem CID 114712252) has the molecular formula C17H24N2O and a molecular weight of 272.39 g/mol. Its IUPAC name is 1'-cyclopropyl-N-ethylspiro[3,4-dihydrochromene-2,3'-pyrrolidine]-4-amine.

Molecular Properties

Compound Name1'-cyclopropyl-N-ethylspiro[3,4-dihydrochromene-2,3'-pyrrolidine]-4-amine
PubChem CID114712252
Molecular FormulaC17H24N2O
Molecular Weight272.39 g/mol
Exact Mass272.19
IUPAC Name1'-cyclopropyl-N-ethylspiro[3,4-dihydrochromene-2,3'-pyrrolidine]-4-amine
SMILESCCNC1CC2(CCN(C3CC3)C2)Oc2ccccc21
InChIInChI=1S/C17H24N2O/c1-2-18-15-11-17(9-10-19(12-17)13-7-8-13)20-16-6-4-3-5-14(15)16/h3-6,13,15,18H,2,7-12H2,1H3
InChIKeyCPLMVGQYKPDYDD-UHFFFAOYSA-N
XLogP2.73
TPSA24.50 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500272.39
LogP ≤ 52.73
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

N-ethyl-1'-methylspiro[3,4-dihydrochromene-2,3'-pyrrolidine]-4-amine
CID 114712287
N-ethyl-1'-methylspiro[3,4-dihydrochromene-2,3'-piperidine]-4-amine
CID 114712286
1'-cyclopropylspiro[3,4-dihydrochromene-2,3'-pyrrolidine]-4-ol
CID 114714851
N-ethyl-4'-methylspiro[3,4-dihydrochromene-2,1'-cyclohexane]-4-amine
CID 114712239
N-ethyl-4',4'-dimethylspiro[3,4-dihydrochromene-2,1'-cycloheptane]-4-amine
CID 114712158
1'-cyclopropyl-N,6-dimethylspiro[3,4-dihydrochromene-2,3'-pyrrolidine]-4-amine
CID 114712574
N-ethyl-2'-propylspiro[3,4-dihydrochromene-2,4'-oxane]-4-amine
CID 114712323
N-ethyl-7-methoxy-1'-methylspiro[3,4-dihydrochromene-2,3'-pyrrolidine]-4-amine
CID 114711027
7-bromo-N-ethyl-1'-methylspiro[3,4-dihydrochromene-2,3'-piperidine]-4-amine
CID 114711803
N-ethyl-2,2-bis(2-methylpropyl)-3,4-dihydrochromen-4-amine
CID 114868375
(4S)-1'-cyclopropyl-6-methylspiro[3,4-dihydrochromene-2,3'-pyrrolidine]-4-amine
CID 104946423
2-(cyclopropylmethyl)-N-ethyl-2-methyl-3,4-dihydrochromen-4-amine
CID 114712262

Frequently Asked Questions

What is the IUPAC name of 1'-cyclopropyl-N-ethylspiro[3,4-dihydrochromene-2,3'-pyrrolidine]-4-amine?
The IUPAC name of 1'-cyclopropyl-N-ethylspiro[3,4-dihydrochromene-2,3'-pyrrolidine]-4-amine (CID 114712252) is 1'-cyclopropyl-N-ethylspiro[3,4-dihydrochromene-2,3'-pyrrolidine]-4-amine.
What is the SMILES notation for 1'-cyclopropyl-N-ethylspiro[3,4-dihydrochromene-2,3'-pyrrolidine]-4-amine?
The canonical SMILES for 1'-cyclopropyl-N-ethylspiro[3,4-dihydrochromene-2,3'-pyrrolidine]-4-amine is CCNC1CC2(CCN(C3CC3)C2)Oc2ccccc21.
What is the InChIKey of 1'-cyclopropyl-N-ethylspiro[3,4-dihydrochromene-2,3'-pyrrolidine]-4-amine?
The InChIKey is CPLMVGQYKPDYDD-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H24N2O/c1-2-18-15-11-17(9-10-19(12-17)13-7-8-13)20-16-6-4-3-5-14(15)16/h3-6,13,15,18H,2,7-12H2,1H3.
What are the key properties of 1'-cyclopropyl-N-ethylspiro[3,4-dihydrochromene-2,3'-pyrrolidine]-4-amine?
1'-cyclopropyl-N-ethylspiro[3,4-dihydrochromene-2,3'-pyrrolidine]-4-amine has a molecular weight of 272.39 g/mol, XLogP of 2.73, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1'-cyclopropyl-N-ethylspiro[3,4-dihydrochromene-2,3'-pyrrolidine]-4-amine is sourced from PubChem (CID 114712252), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).